2-(1,3-thiazol-2-ylsulfonyl)octanoic acid

Systemtic Name: 2-(1,3-thiazol-2-ylsulfonyl)octanoic acid Openeye Name: 2-thiazol-2-ylsulfonyloctanoic acid CAS Name: 2-(2-thiazolylsulfonyl)octanoic acid IUPAC Name: 2-(1,3-thiazol-2-ylsulfonyl)octanoic acid Traditional Name: 2-thiazol-2-ylsulfonylcaprylic acid Formula: C11H17NO4S2 MolecularWeight: 291.38698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)S(=O)(=O)C1=NC=CS1

Isomeric SMILES

CCCCCCC(C(=O)O)S(=O)(=O)C1=NC=CS1

InChI

InChI=1S/C11H17NO4S2/c1-2-3-4-5-6-9(10(13)14)18(15,16)11-12-7-8-17-11/h7-9H,2-6H2,1H3,(H,13,14)